Home Other Building Blocks 2,3,4,5-Tetrahydro-1h-benzo[e][1,4]diazepin-7-ol

2,3,4,5-Tetrahydro-1h-benzo[e][1,4]diazepin-7-ol

CAS No.:
886366-76-3
Catalog Number:
AG004AEM
Molecular Formula:
C9H12N2O
Molecular Weight:
164.2044
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$135
- +
250mg
97%
1 week
United States
$205
- +
Product Description
Catalog Number:
AG004AEM
Chemical Name:
2,3,4,5-Tetrahydro-1h-benzo[e][1,4]diazepin-7-ol
CAS Number:
886366-76-3
Molecular Formula:
C9H12N2O
Molecular Weight:
164.2044
MDL Number:
MFCD07369989
IUPAC Name:
2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-7-ol
InChI:
InChI=1S/C9H12N2O/c12-8-1-2-9-7(5-8)6-10-3-4-11-9/h1-2,5,10-12H,3-4,6H2
InChI Key:
JQYCOQDSDCFYKU-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CNCCN2
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
164.208g/mol
Monoisotopic Mass:
164.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties